3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide

C11H21NO — CID 118084477

IUPAC3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide
SMILESCN(C)C(=O)C1CC(C(C)(C)C)C1
InChIInChI=1S/C11H21NO/c1-11(2,3)9-6-8(7-9)10(13)12(4)5/h8-9H,6-7H2,1-5H3
InChIKeyDCMSPRBKGPAGLU-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.15
Rot. Bonds1

About 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide

3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide (PubChem CID 118084477) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide.

Molecular Properties

Compound Name3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide
PubChem CID118084477
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide
SMILESCN(C)C(=O)C1CC(C(C)(C)C)C1
InChIInChI=1S/C11H21NO/c1-11(2,3)9-6-8(7-9)10(13)12(4)5/h8-9H,6-7H2,1-5H3
InChIKeyDCMSPRBKGPAGLU-UHFFFAOYSA-N
XLogP2.15
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide?
The IUPAC name of 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide (CID 118084477) is 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide.
What is the SMILES notation for 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide?
The canonical SMILES for 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide is CN(C)C(=O)C1CC(C(C)(C)C)C1.
What is the InChIKey of 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide?
The InChIKey is DCMSPRBKGPAGLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-11(2,3)9-6-8(7-9)10(13)12(4)5/h8-9H,6-7H2,1-5H3.
What are the key properties of 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide?
3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide has a molecular weight of 183.29 g/mol, XLogP of 2.15, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-N,N-dimethylcyclobutane-1-carboxamide is sourced from PubChem (CID 118084477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).